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6-FLUORO-3-(9-METHYL-3,9-DIAZABICYCLO-[3.3.1]-NONAN-3-YL)-DIBENZO-[B,D]-THIOPHENE-5,5-DIOXIDE
SpectraBase Compound ID ImYh9dpbnB6
InChI InChI=1S/C20H21FN2O2S/c1-22-14-4-2-5-15(22)12-23(11-14)13-8-9-16-17-6-3-7-18(21)20(17)26(24,25)19(16)10-13/h3,6-10,14-15H,2,4-5,11-12H2,1H3/t14-,15-/m1/s1
InChIKey LXUUFHQPGYWJGI-HUUCEWRRSA-N
Mol Weight 372.46 g/mol
Molecular Formula C20H21FN2O2S
Exact Mass 372.130777 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2q6O8Iv042s
Name 6-FLUORO-3-(9-METHYL-3,9-DIAZABICYCLO-[3.3.1]-NONAN-3-YL)-DIBENZO-[B,D]-THIOPHENE-5,5-DIOXIDE
Compound Number 12 B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21FN2O2S
InChI InChI=1S/C20H21FN2O2S/c1-22-14-4-2-5-15(22)12-23(11-14)13-8-9-16-17-6-3-7-18(21)20(17)26(24,25)19(16)10-13/h3,6-10,14-15H,2,4-5,11-12H2,1H3/t14-,15-/m1/s1
InChIKey LXUUFHQPGYWJGI-HUUCEWRRSA-N
Literature Reference Author R.TEODORO,M.SCHEUNEMANN,W.DEUTHER-CONRAD,B.WENZEL,F.M.FASOLI ,C.GOTTI,M.KRANZ,C.K
Literature Reference Citation MOLECULES,20,18387(2015)
Literature Reference DOI 10.3390/molecules201018387
Solvent CDCl3
Source File Reference UWPA5230